(2S)-4-(2-Acetamido-2-Carboxy-Ethyl)Sulfanyl-2-Amino-Butanoic Acid
[CAS# 20619-80-1]

Identification

• Name: (2S)-4-(2-Acetamido-2-Carboxy-Ethyl)Sulfanyl-2-Amino-Butanoic Acid
• Synonyms: (2S)-4-(2-Acetamido-3-Hydroxy-3-Oxo-Propyl)Sulfanyl-2-Amino-Butanoic Acid; (2S)-4-[(2-Acetamido-3-Hydroxy-3-Oxopropyl)Thio]-2-Aminobutanoic Acid; (2S)-4-[(2-Acetamido-3-Hydroxy-3-Keto-Propyl)Thio]-2-Amino-Butyric Acid
• Molecular Formula: C₉H₁₆N₂O₅S
• Molecular Weight: 264.30
• CAS Registry Number: 20619-80-1
• SMILES: [C@H](C(=O)O)(N)CCSCC(C(=O)O)NC(=O)C
• InChI: 1S/C9H16N2O5S/c1-5(12)11-7(9(15)16)4-17-3-2-6(10)8(13)14/h6-7H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t6-,7?/m0/s1
• InChIKey: QWACVTVBTRSCRL-PKPIPKONSA-N

Properties

• Density: 1.386g/cm³ (Cal.)
• Boiling point: 610.508°C at 760 mmHg (Cal.)
• Flash point: 323.024°C (Cal.)